N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride

C13H27ClN2O — CID 119589343

IUPACN-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride
SMILESCCCCC(=O)NC(CN)C1CCCCC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-2-3-9-13(16)15-12(10-14)11-7-5-4-6-8-11;/h11-12H,2-10,14H2,1H3,(H,15,16);1H
InChIKeyDUMALQZITUPADD-UHFFFAOYSA-N
MW262.82 g/mol
LogP2.62
Rot. Bonds6

About N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride

N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride (PubChem CID 119589343) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride
PubChem CID119589343
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC NameN-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride
SMILESCCCCC(=O)NC(CN)C1CCCCC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-2-3-9-13(16)15-12(10-14)11-7-5-4-6-8-11;/h11-12H,2-10,14H2,1H3,(H,15,16);1H
InChIKeyDUMALQZITUPADD-UHFFFAOYSA-N
XLogP2.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(2-amino-1-cyclohexylethyl)-2-pentoxyacetamide;hydrochloride
CID 119589204
N-(2-amino-1-cyclopentylethyl)-3-cyclohexylpropanamide
CID 106737712
2-acetamido-N-(2-amino-1-cyclohexylethyl)acetamide;hydrochloride
CID 119590269
N-(2-amino-1-cyclohexylethyl)-4,4,4-trifluorobutanamide
CID 81486060
3-amino-N-(1-cyclobutylpentyl)propanamide
CID 119039170
N-(2-amino-1-cyclohexylethyl)-2-ethylhexanamide
CID 81486044
N-(2-amino-1-cyclopentylethyl)-3-methylbutanamide
CID 106737373
N-(2-amino-1-cyclohexylethyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 119589025
N-(2-amino-1-cyclohexylethyl)-4-methylcyclohexane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride (CID 119589343) is N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride is CCCCC(=O)NC(CN)C1CCCCC1.Cl.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride?
The InChIKey is DUMALQZITUPADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-2-3-9-13(16)15-12(10-14)11-7-5-4-6-8-11;/h11-12H,2-10,14H2,1H3,(H,15,16);1H.
What are the key properties of N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride?
N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)pentanamide;hydrochloride is sourced from PubChem (CID 119589343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).